2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(1,3-benzothiazol-2-yl)piperidino]propanoylamino]thiophene-3-carboxamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N4O2S2/c1-12(18(26)23-20-14(17(21)25)8-11-27-20)24-9-6-13(7-10-24)19-22-15-4-2-3-5-16(15)28-19/h2-5,8,11-13H,6-7,9-10H2,1H3,(H2,21,25)(H,23,26)